| CAS Number | 773868-64-7 |
| Catalog Number | AG005BKT(AGN-PC-015QNT) |
| Chemical Name | (4-(Difluoromethoxy)-3-ethoxyphenyl)methanol |
| IUPAC Name | [4-(difluoromethoxy)-3-ethoxyphenyl]methanol |
| InChI | InChI=1S/C10H12F2O3/c1-2-14-9-5-7(6-13)3-4-8(9)15-10(11)12/h3-5,10,13H,2,6H2,1H3 |
| InChI Key | VXMJDFNIBAXTPH-UHFFFAOYSA-N |
| MDL Number | MFCD06202711 |
| Molecular Formula | C10H12F2O3 |
| Molecular Weight | 218.1973 |
| SMILES | CCOC1=C(OC(F)F)C=CC(CO)=C1 |
| Synonyms | 773868-64-7,
[4-(difluoromethoxy)-3-ethoxyphenyl]methanol,
(4-(Difluoromethoxy)-3-ethoxyphenyl)methanol,
Benzenemethanol,4-(difluoromethoxy)-3-ethoxy-,
AC1Q35UK,
SCHEMBL16955648,
CTK5E4362,
DTXSID10588122,
ZINC14120928,
AKOS000125464,
MCULE-5891358499,
EN300-29662,
Benzenemethanol,4- -3-ethoxy-,
Benzenemethanol, 4-(difluoromethoxy)-3-ethoxy- (9CI),
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| Complexity | 178 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 218.075g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 218.2g/mol |
| Monoisotopic Mass | 218.075g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 38.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
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Certificate of Analysis
Lot Number